UCSF

ZINC09088193

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 2007 28 No

Popular Name: 4-(2-furoyl)-3-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one 4-(2-furoyl)-3-hydroxy-1-[2-(2-h…

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Other Names:

MFCD04028311

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.95 2.92 -68.05 1 8 -1 112 386.38 9 ↓
Mid Mid (pH 6-8) 0.37 -2.12 -17.9 1 8 0 106 387.388 9 ↓
Lo Low (pH 4.5-6) 0.95 2.1 -20.63 2 8 0 109 387.388 9 ↓

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )